(1-azanyl-1-oxidanylidene-propan-2-yl) 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 3-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propanoate CAS Name: 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate Traditional Name: 3-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propionic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C12H13N3O5S MolecularWeight: 311.31372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)CCN1C(=O)OC(=N1)C2=CC=CS2

Isomeric SMILES

CC(C(=O)N)OC(=O)CCN1C(=O)OC(=N1)C2=CC=CS2

InChI

InChI=1S/C12H13N3O5S/c1-7(10(13)17)19-9(16)4-5-15-12(18)20-11(14-15)8-3-2-6-21-8/h2-3,6-7H,4-5H2,1H3,(H2,13,17)